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Chemistry

Mol. Mass

209.29

ALogP

1.78

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CCC1=C[C@@H]2[C@H](C1)C[C@]2(CN)CC(=O)O
  • InChIKey: FTBQORVNHOIASH-CKYFFXLPSA-N
    InChI=1S/C12H19NO2/c1-2-8-3-9-5-12(7-13,6-11(14)15)10(9)4-8/h4,9-10H,2-3,5-7,13H2,1H3,(H,14,15)/t9-,10-,12-/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL3545125   ChEMBL
mirogabalin

Mirogabalin   Wikipedia

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